2-azanyl-5-[azanyl-[9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzene-1,4-disulfonic acid

Systemtic Name: 2-azanyl-5-[azanyl-[9,10-bis(oxidanylidene)anthracen-1-yl]amino]benzene-1,4-disulfonic acid Openeye Name: 2-amino-5-[amino-(9,10-dioxo-1-anthryl)amino]benzene-1,4-disulfonic acid CAS Name: 2-amino-5-[amino-(9,10-dioxo-1-anthracenyl)amino]benzene-1,4-disulfonic acid IUPAC Name: 2-amino-5-[amino-(9,10-dioxoanthracen-1-yl)amino]benzene-1,4-disulfonic acid Traditional Name: 2-amino-5-[amino-(9,10-diketo-1-anthryl)amino]benzene-1,4-disulfonic acid Formula: C20H15N3O8S2 MolecularWeight: 489.4784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)N(C4=C(C=C(C(=C4)S(=O)(=O)O)N)S(=O)(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)N(C4=C(C=C(C(=C4)S(=O)(=O)O)N)S(=O)(=O)O)N

InChI

InChI=1S/C20H15N3O8S2/c21-13-8-17(33(29,30)31)15(9-16(13)32(26,27)28)23(22)14-7-3-6-12-18(14)20(25)11-5-2-1-4-10(11)19(12)24/h1-9H,21-22H2,(H,26,27,28)(H,29,30,31)